SCHEMBL10959321

SCHEMBL10959321

O=P(O)(O)Cn1cncn1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.56
EGLN3 Q9H6Z9 1/20 0.47
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CYP19A1 P11511 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10882663 0.75 FDPS (0.53) FDPSEGLN3
Hydrochloric Acid SCHEMBL10887783 0.72 FDPS (0.46) FDPS
SCHEMBL10884743 0.71 FDPS (0.45) FDPSEGLN3CYP19A1
SCHEMBL10884751 0.71 FDPS (0.45) FDPSEGLN3CYP19A1
SCHEMBL10626196 0.70 FDPS (0.70) FDPSEGLN3
SCHEMBL5899076 0.68 EGLN3 (0.55) FDPSEGLN3HDAC1HDAC6CYP19A1
SCHEMBL5657617 0.68 CYP19A1 (0.48) FDPSEGLN3CYP19A1
SCHEMBL10624303 0.67 FDPS (0.66) FDPSEGLN3
SCHEMBL1289831 0.67
SCHEMBL9000195 0.66 FDPS (0.51) FDPSEGLN3HDAC1HDAC6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118450729-A Hole transport layer, trans-perovskite battery and preparation method of trans-perovskite battery 四川恒立聚能光电科技有限公司 2024-08-06 CN claimed
EP-0063099-B1 PROCESS FOR THE PREPARATION OF PHENYLETHYL TRIAZOLES CIBA-GEIGY AG (CH) 1985-11-27 EP claimed
EP-0063099-A2 Process for the preparation of phenylethyl triazoles CIBA-GEIGY AG (CH) 1982-10-20 EP claimed
CN-118450729-A Hole transport layer, trans-perovskite battery and preparation method of trans-perovskite battery 四川恒立聚能光电科技有限公司 2024-08-06 CN disclosed
CN-1207298-C Triazolopurine derivatives, drug compositions containing the same and adenosine A3 receptor affinitive agents OTSUKA PHARMA CO LTD (JP) 2005-06-22 CN disclosed
CN-1376157-A Triazolopurine derivatives, drug compositions containing the same and adenosine A3 receptor affinitive agents OTSUKA PHARMA CO LTD (JP) 2002-10-23 CN disclosed
EP-0063099-B1 PROCESS FOR THE PREPARATION OF PHENYLETHYL TRIAZOLES CIBA-GEIGY AG (CH) 1985-11-27 EP disclosed
US-4497647-A Triazolylalkenes as fungicides and plant growth regulants CIBA-GEIGY CORPORATION (US) 1985-02-05 US disclosed
EP-0063099-A2 Process for the preparation of phenylethyl triazoles CIBA-GEIGY AG (CH) 1982-10-20 EP disclosed
EP-0063099-A2 Process for the preparation of phenylethyl triazoles CIBA-GEIGY AG (CH) 1982-10-20 EP disclosed